Introduction:Basic information about CAS 1671-82-5|1H-Imidazole,1-methyl-2-nitro-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1H-Imidazole,1-methyl-2-nitro- |
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| CAS Number | 1671-82-5 | Molecular Weight | 127.10100 |
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| Density | 1.44g/cm3 | Boiling Point | 308.9ºC at 760mmHg |
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| Molecular Formula | C4H5N3O2 | Melting Point | / |
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| MSDS | / | Flash Point | 140.6ºC |
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Names
| Name | 1-methyl-2-nitroimidazole |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.44g/cm3 |
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| Boiling Point | 308.9ºC at 760mmHg |
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| Molecular Formula | C4H5N3O2 |
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| Molecular Weight | 127.10100 |
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| Flash Point | 140.6ºC |
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| Exact Mass | 127.03800 |
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| PSA | 63.64000 |
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| LogP | 0.85150 |
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| Vapour Pressure | 0.000662mmHg at 25°C |
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| Index of Refraction | 1.618 |
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| InChIKey | HBMINVNVQUDERA-UHFFFAOYSA-N |
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| SMILES | Cn1ccnc1[N+](=O)[O-] |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- NI7500000
- CHEMICAL NAME :
- Imidazole, 1-methyl-2-nitro-
- CAS REGISTRY NUMBER :
- 1671-82-5
- BEILSTEIN REFERENCE NO. :
- 0607942
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 6
- MOLECULAR FORMULA :
- C4-H5-N3-O2
- MOLECULAR WEIGHT :
- 127.12
- WISWESSER LINE NOTATION :
- T5N CNJ A1 BNW
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 126 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 126 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 158 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
MUTATION DATA - TYPE OF TEST :
- Mutation in microorganisms
- TEST SYSTEM :
- Bacteria - Escherichia coli
- DOSE/DURATION :
- 5 umol/L
- REFERENCE :
- BJCSB5 British Journal of Cancer, Supplement. (Macmillan Press Ltd., Houndmills, Basingstoke, Hants. RG21 2ZS, UK) No.1- 1973- Volume(issue)/page/year: 3,60,1978 *** REVIEWS *** TOXICOLOGY REVIEW ADCMAZ Advances in Chemotherapy. (New York, NY) V.1-3, 1964-68. For publisher information, see AVPCAQ. Volume(issue)/page/year: 3,39,1968
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Synonyms
| 1-METHYL-2-NITRO-1H-IMIDAZOLE |
| 1H-Imidazole,1-methyl-2-nitro |
| Imidazole,1-methyl-2-nitro |